5-ethanoyl-3-[(E)-3-(4-hydroxyphenyl)prop-2-enoyl]-6-oxidanyl-pyran-2,4-dione

Systemtic Name: 5-ethanoyl-3-[(E)-3-(4-hydroxyphenyl)prop-2-enoyl]-6-oxidanyl-pyran-2,4-dione Openeye Name: 5-acetyl-6-hydroxy-3-[(E)-3-(4-hydroxyphenyl)prop-2-enoyl]pyran-2,4-dione CAS Name: 5-acetyl-6-hydroxy-3-[(E)-3-(4-hydroxyphenyl)-1-oxoprop-2-enyl]pyran-2,4-dione IUPAC Name: 5-acetyl-6-hydroxy-3-[(E)-3-(4-hydroxyphenyl)prop-2-enoyl]pyran-2,4-dione Traditional Name: 5-acetyl-6-hydroxy-3-[(E)-3-(4-hydroxyphenyl)acryloyl]pyran-2,4-quinone Formula: C16H12O7 MolecularWeight: 316.26228

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=C(OC(=O)C(C1=O)C(=O)C=CC2=CC=C(C=C2)O)O

Isomeric SMILES

CC(=O)C1=C(OC(=O)C(C1=O)C(=O)/C=C/C2=CC=C(C=C2)O)O

InChI

InChI=1S/C16H12O7/c1-8(17)12-14(20)13(16(22)23-15(12)21)11(19)7-4-9-2-5-10(18)6-3-9/h2-7,13,18,21H,1H3/b7-4+